COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.409   3.156  -0.361  1.00  0.00           C  
HETATM    2  N   UNL     1      -7.154   2.518   0.043  1.00  0.00           N  
HETATM    3  C   UNL     1      -6.590   1.444  -0.543  1.00  0.00           C  
HETATM    4  N   UNL     1      -6.331   2.923   1.101  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.304   2.118   1.161  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.435   1.165   0.131  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.491   0.061  -0.167  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.343  -0.103   0.609  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.754  -0.816  -1.221  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.888  -1.834  -1.498  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.733  -2.002  -0.728  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.798  -3.102  -1.030  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.110  -4.012  -1.973  1.00  0.00           O  
HETATM   14  O   UNL     1      -0.746  -3.188  -0.427  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.468  -1.129   0.331  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.227  -1.310   1.168  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.032  -0.680   0.450  1.00  0.00           C  
HETATM   18  C   UNL     1       1.208  -0.861   1.286  1.00  0.00           C  
HETATM   19  O   UNL     1       1.143  -1.438   2.352  1.00  0.00           O  
HETATM   20  C   UNL     1       2.494  -0.341   0.813  1.00  0.00           C  
HETATM   21  C   UNL     1       3.651  -0.509   1.590  1.00  0.00           C  
HETATM   22  F   UNL     1       3.581  -1.151   2.777  1.00  0.00           F  
HETATM   23  C   UNL     1       4.857  -0.018   1.141  1.00  0.00           C  
HETATM   24  C   UNL     1       2.573   0.322  -0.422  1.00  0.00           C  
HETATM   25  F   UNL     1       1.464   0.482  -1.177  1.00  0.00           F  
HETATM   26  C   UNL     1       3.784   0.810  -0.863  1.00  0.00           C  
HETATM   27  C   UNL     1       4.930   0.646  -0.084  1.00  0.00           C  
HETATM   28  C   UNL     1       6.230   1.172  -0.563  1.00  0.00           C  
HETATM   29  C   UNL     1       7.428   1.081   0.088  1.00  0.00           C  
HETATM   30  N   UNL     1       8.356   1.682  -0.681  1.00  0.00           N  
HETATM   31  N   UNL     1       7.727   2.160  -1.836  1.00  0.00           N  
HETATM   32  C   UNL     1       6.458   1.854  -1.775  1.00  0.00           C  
HETATM   33  H   UNL     1      -9.240   2.695   0.173  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.369   4.219  -0.124  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.552   3.029  -1.434  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.981   0.901  -1.391  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.494   2.175   1.873  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.142   0.573   1.426  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.645  -0.689  -1.817  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.095  -2.511  -2.314  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.465  -4.715  -2.135  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.367  -0.827   2.134  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.042  -2.374   1.316  1.00  0.00           H  
HETATM   44  H   UNL     1       0.108  -1.163  -0.517  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.217   0.384   0.301  1.00  0.00           H  
HETATM   46  H   UNL     1       5.748  -0.146   1.739  1.00  0.00           H  
HETATM   47  H   UNL     1       3.846   1.320  -1.813  1.00  0.00           H  
HETATM   48  H   UNL     1       7.600   0.611   1.045  1.00  0.00           H  
HETATM   49  H   UNL     1       9.299   1.769  -0.470  1.00  0.00           H  
HETATM   50  H   UNL     1       5.713   2.086  -2.522  1.00  0.00           H  
CONECT    1    2   33   34   35                                       
CONECT    2    4    1    3                                            
CONECT    3    6    6    2   36                                       
CONECT    4    5    5    2                                            
CONECT    5    4    4    6   37                                       
CONECT    6    5    7    3    3                                       
CONECT    7    9    6    8    8                                       
CONECT    8    7    7   15   38                                       
CONECT    9   10   10    7   39                                       
CONECT   10    9    9   11   40                                       
CONECT   11   10   12   15   15                                       
CONECT   12   14   14   11   13                                       
CONECT   13   12   41                                                 
CONECT   14   12   12                                                 
CONECT   15   11   11    8   16                                       
CONECT   16   15   17   42   43                                       
CONECT   17   16   18   44   45                                       
CONECT   18   17   19   19   20                                       
CONECT   19   18   18                                                 
CONECT   20   24   18   21   21                                       
CONECT   21   20   20   23   22                                       
CONECT   22   21                                                      
CONECT   23   27   27   21   46                                       
CONECT   24   25   26   26   20                                       
CONECT   25   24                                                      
CONECT   26   24   24   27   47                                       
CONECT   27   26   28   23   23                                       
CONECT   28   29   29   27   32                                       
CONECT   29   30   28   28   48                                       
CONECT   30   29   31   49                                            
CONECT   31   30   32   32                                            
CONECT   32   28   31   31   50                                       
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    5                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   23                                                      
CONECT   47   26                                                      
CONECT   48   29                                                      
CONECT   49   30                                                      
CONECT   50   32                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
